Chemical ID: 4332370

Cc1ccccc1OCC(=O)N2C(CC(=N2)C)(c3cccnc3)O
Chemical ID:
4332370
Name [?]:
1-[5-hydroxy-3-methyl-5-(3-pyridyl)-4H-pyrazol-1-yl]-2-(2-methylphenoxy)-ethanone
SMILES [?]:
Cc1ccccc1OCC(=O)N2C(CC(=N2)C)(c3cccnc3)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H19N3O3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:1
ZAP Information [?]
Total:8.74511
Area:531.772
Solvation:-4.54919
Coulombic:-45.5781
Bond Count [?]
All:26
Single:18
Double:8
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:325.362
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:1.99
LogP (Chemaxon):3.22

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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